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CHEBI:200019 - Asperdiazapinone D

ChEBI IDCHEBI:200019
ChEBI NameAsperdiazapinone D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H23N3O3
Net Charge0
Average Mass389.455
Monoisotopic Mass389.17394
SMILESCC(C)=CCn1cc(C[C@@H]2NC(=O)c3ccccc3NC2=O)c2ccc(O)cc21
InChIInChI=1S/C23H23N3O3/c1-14(2)9-10-26-13-15(17-8-7-16(27)12-21(17)26)11-20-23(29)24-19-6-4-3-5-18(19)22(28)25-20/h3-9,12-13,20,27H,10-11H2,1-2H3,(H,24,29)(H,25,28)/t20-/m0/s1
InChIKeyHYQKMMLPLDEDQP-FQEVSTJZSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - DOI (10.1016/j.tet.2013.11.009)
Roles Classification
Biological Role:
GABA modulator  A substance that does not act as agonist or antagonist but does affect the gamma-aminobutyric acid receptor-ionophore complex. GABA-A receptors appear to have at least three allosteric sites at which modulators act: a site at which benzodiazepines act by increasing the opening frequency of gamma-aminobutyric acid-activated chloride channels; a site at which barbiturates act to prolong the duration of channel opening; and a site at which some steroids may act.
Application:
GABA modulator  A substance that does not act as agonist or antagonist but does affect the gamma-aminobutyric acid receptor-ionophore complex. GABA-A receptors appear to have at least three allosteric sites at which modulators act: a site at which benzodiazepines act by increasing the opening frequency of gamma-aminobutyric acid-activated chloride channels; a site at which barbiturates act to prolong the duration of channel opening; and a site at which some steroids may act.
ChEBI Ontology
Outgoing Relation(s)
Asperdiazapinone D (CHEBI:200019) is a benzodiazepine (CHEBI:22720)
IUPAC Name 
(3S)-3-[[6-hydroxy-1-(3-methylbut-2-enyl)indol-3-yl]methyl]-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione
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